CID 53484308

1221715-81-6

Structural Information

Molecular Formula
C11H19NO3
SMILES
CC(C)(C)OC(=O)N1CC(C1)OCC=C
InChI
InChI=1S/C11H19NO3/c1-5-6-14-9-7-12(8-9)10(13)15-11(2,3)4/h5,9H,1,6-8H2,2-4H3
InChIKey
PZYUTLNRBHWRIR-UHFFFAOYSA-N
Compound name
tert-butyl 3-prop-2-enoxyazetidine-1-carboxylate
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

7
Patents

213.13649 Da
Monoisotopic Mass

1.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 214.14377 149.7
[M+Na]+ 236.12571 154.7
[M-H]- 212.12921 151.6
[M+NH4]+ 231.17031 161.0
[M+K]+ 252.09965 157.4
[M+H-H2O]+ 196.13375 138.8
[M+HCOO]- 258.13469 167.5
[M+CH3COO]- 272.15034 190.5
[M+Na-2H]- 234.11116 152.7
[M]+ 213.13594 160.9
[M]- 213.13704 160.9
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe